5-(5-cyano-2-methylanilino)pyridine-2-carbonitrile

C14H10N4 — CID 115487650

IUPAC5-(5-cyano-2-methylanilino)pyridine-2-carbonitrile
SMILESCc1ccc(C#N)cc1Nc1ccc(C#N)nc1
InChIInChI=1S/C14H10N4/c1-10-2-3-11(7-15)6-14(10)18-13-5-4-12(8-16)17-9-13/h2-6,9,18H,1H3
InChIKeyGZUMASIVNGPUEN-UHFFFAOYSA-N
MW234.26 g/mol
LogP2.88
Rot. Bonds2

About 5-(5-cyano-2-methylanilino)pyridine-2-carbonitrile

5-(5-cyano-2-methylanilino)pyridine-2-carbonitrile (PubChem CID 115487650) has the molecular formula C14H10N4 and a molecular weight of 234.26 g/mol. Its IUPAC name is 5-(5-cyano-2-methylanilino)pyridine-2-carbonitrile.

Molecular Properties

Compound Name5-(5-cyano-2-methylanilino)pyridine-2-carbonitrile
PubChem CID115487650
Molecular FormulaC14H10N4
Molecular Weight234.26 g/mol
Exact Mass234.09
IUPAC Name5-(5-cyano-2-methylanilino)pyridine-2-carbonitrile
SMILESCc1ccc(C#N)cc1Nc1ccc(C#N)nc1
InChIInChI=1S/C14H10N4/c1-10-2-3-11(7-15)6-14(10)18-13-5-4-12(8-16)17-9-13/h2-6,9,18H,1H3
InChIKeyGZUMASIVNGPUEN-UHFFFAOYSA-N
XLogP2.88
TPSA72.50 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.26
LogP ≤ 52.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-methyl-3-(1H-pyrazol-4-ylamino)benzonitrile
CID 125449573
5-(4-bromo-2,6-dimethylanilino)pyridine-2-carbonitrile
CID 115487739
5-(2,6-difluoro-3-methylanilino)pyridine-2-carbonitrile
CID 82818919
5-(2-methoxy-5-methylanilino)pyridine-2-carbonitrile
CID 115487429
3-bromo-4-[(6-methyl-3-pyridinyl)amino]benzonitrile
CID 82798416
3-[(4-amino-5-methyl-2-pyridinyl)amino]-4-methylbenzonitrile
CID 83266542
4-(5-amino-2-methylanilino)benzonitrile
CID 62588662
3-[(5-aminopyrimidin-4-yl)amino]-4-methylbenzonitrile
CID 79917359
5-(2-bromoanilino)pyridine-2-carbonitrile
CID 115487447
5-(3,5-dimethoxyanilino)pyridine-2-carbonitrile
CID 115487418
5-[(2-methylquinolin-8-yl)amino]pyridine-2-carbonitrile
CID 115487676
5-amino-2-(5-cyano-2-methylanilino)pyridine-3-carbonitrile
CID 62103720

Frequently Asked Questions

What is the IUPAC name of 5-(5-cyano-2-methylanilino)pyridine-2-carbonitrile?
The IUPAC name of 5-(5-cyano-2-methylanilino)pyridine-2-carbonitrile (CID 115487650) is 5-(5-cyano-2-methylanilino)pyridine-2-carbonitrile.
What is the SMILES notation for 5-(5-cyano-2-methylanilino)pyridine-2-carbonitrile?
The canonical SMILES for 5-(5-cyano-2-methylanilino)pyridine-2-carbonitrile is Cc1ccc(C#N)cc1Nc1ccc(C#N)nc1.
What is the InChIKey of 5-(5-cyano-2-methylanilino)pyridine-2-carbonitrile?
The InChIKey is GZUMASIVNGPUEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10N4/c1-10-2-3-11(7-15)6-14(10)18-13-5-4-12(8-16)17-9-13/h2-6,9,18H,1H3.
What are the key properties of 5-(5-cyano-2-methylanilino)pyridine-2-carbonitrile?
5-(5-cyano-2-methylanilino)pyridine-2-carbonitrile has a molecular weight of 234.26 g/mol, XLogP of 2.88, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(5-cyano-2-methylanilino)pyridine-2-carbonitrile is sourced from PubChem (CID 115487650), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).